Geometry & MOs

Info

ID:	382147
PubChem CID:	134973107
Reduced:	BrO2N6C19H21 (1)
Stoich.:	AB2C6D19E21 (1)
Weight, g/mol:	343.179696
ΔH_f, kcal/mol:	8.67
Dipole, Da:	11.9
IP(EA), eV:	-8.56(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methylideneamino)-N-[[6-[[2-(methylideneamino)anilino]methyl]pyridin-2-yl]methyl]aniline

Drug info:

PubChemData

Smile

CN(C)/C=N/C1=NC2=C(C(=O)N1CC3=CC=CC=C3)N=C(N2C4CCCO4)Br

DOS

IR

Vibrations